1,3-diethyl-7-(oxiran-2-ylmethyl)purine-2,6-dione

Systemtic Name: 1,3-diethyl-7-(oxiran-2-ylmethyl)purine-2,6-dione Openeye Name: 1,3-diethyl-7-(oxiran-2-ylmethyl)purine-2,6-dione CAS Name: 1,3-diethyl-7-(2-oxiranylmethyl)purine-2,6-dione IUPAC Name: 1,3-diethyl-7-(oxiran-2-ylmethyl)purine-2,6-dione Traditional Name: 1,3-diethyl-7-glycidyl-xanthine Formula: C12H16N4O3 MolecularWeight: 264.28044

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N(C1=O)CC)N(C=N2)CC3CO3

Isomeric SMILES

CCN1C2=C(C(=O)N(C1=O)CC)N(C=N2)CC3CO3

InChI

InChI=1S/C12H16N4O3/c1-3-15-10-9(11(17)16(4-2)12(15)18)14(7-13-10)5-8-6-19-8/h7-8H,3-6H2,1-2H3